bromanyl-tris[(3-methyl-1,3-benzothiazol-2-ylidene)amino]phosphanium

Systemtic Name: bromanyl-tris[(3-methyl-1,3-benzothiazol-2-ylidene)amino]phosphanium Openeye Name: bromo-tris[(3-methyl-1,3-benzothiazol-2-ylidene)amino]phosphonium CAS Name: bromo-tris[(3-methyl-1,3-benzothiazol-2-ylidene)amino]phosphonium IUPAC Name: bromo-tris[(3-methyl-1,3-benzothiazol-2-ylidene)amino]phosphanium Traditional Name: bromo-tris[(3-methyl-1,3-benzothiazol-2-ylidene)amino]phosphonium Formula: C24H21BrN6PS3+ MolecularWeight: 600.536501

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=N[P+](N=C3N(C4=CC=CC=C4S3)C)(N=C5N(C6=CC=CC=C6S5)C)Br

Isomeric SMILES

CN1C2=CC=CC=C2SC1=N[P+](N=C3N(C4=CC=CC=C4S3)C)(N=C5N(C6=CC=CC=C6S5)C)Br

InChI

InChI=1S/C24H21BrN6PS3/c1-29-16-10-4-7-13-19(16)33-22(29)26-32(25,27-23-30(2)17-11-5-8-14-20(17)34-23)28-24-31(3)18-12-6-9-15-21(18)35-24/h4-15H,1-3H3/q+1